CID 3416581

Fluorescein o-methacrylate

Structural Information

Molecular Formula
C24H16O6
SMILES
CC(=C)C(=O)OC1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)O)C5=CC=CC=C5C(=O)O3
InChI
InChI=1S/C24H16O6/c1-13(2)22(26)28-15-8-10-19-21(12-15)29-20-11-14(25)7-9-18(20)24(19)17-6-4-3-5-16(17)23(27)30-24/h3-12,25H,1H2,2H3
InChIKey
YMHPNLUYVDEYCI-UHFFFAOYSA-N
Compound name
(6'-hydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl) 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

285
Patents

400.0947 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.10198 191.9
[M+Na]+ 423.08392 201.2
[M-H]- 399.08742 200.8
[M+NH4]+ 418.12852 206.2
[M+K]+ 439.05786 198.6
[M+H-H2O]+ 383.09196 184.2
[M+HCOO]- 445.09290 205.5
[M+CH3COO]- 459.10855 202.3
[M+Na-2H]- 421.06937 195.5
[M]+ 400.09415 195.9
[M]- 400.09525 195.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe